| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 20 | Yes |
Popular Name: 3-butyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione 3-butyl-7-(3-methylbutyl)-3,7-di…
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CAS Number: 879351-85-6
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.14 | 0.05 | -10.62 | 1 | 6 | 0 | 72 | 278.356 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.40 | 0.34 | -49.29 | 2 | 6 | 1 | 74 | 279.364 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 16 - 18 | Enamine Building Blocks |
| MP | 16...18 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
